REAL300019814578.mol2 34                                                        
   1       O    -0.51   -17.88    12.49      -3.99      -0.05   -17.93     16
   2       C     0.56    13.70     7.57      86.74       0.66    14.36     16
   3       N    -0.65   -14.81     5.25    -306.12      -1.61   -16.42     16
   4       C     0.12     3.49     6.43      38.15       0.25     3.73     16
   5       C    -0.09    -3.78     8.37      22.60       0.19    -3.59     16
   6       C     0.02     0.70     5.87     -20.05      -0.12     0.58     16
   7       C     0.09     5.06     7.93     137.44       1.09     6.14     16
   8       N    -0.39   -23.98    12.15     -52.23      -0.63   -24.62     16
   9       N    -0.21   -13.67    13.45      37.02       0.50   -13.17     16
  10       N    -0.21   -13.36    13.45      37.02       0.50   -12.86     16
  11       N    -0.38   -22.96    12.15     -52.23      -0.63   -23.60     16
  12       C    -0.08    -2.95     9.69      22.49       0.22    -2.73     16
  13       C    -0.11    -2.82    10.00      22.26       0.22    -2.60     16
  14       C     0.08     2.01     7.31      22.52       0.16     2.18     16
  15       F    -0.13    -2.83    16.80      44.97       0.76    -2.08     16
  16       C    -0.13    -1.98     5.87     -20.08      -0.12    -2.09     16
  17       C    -0.04    -0.48     9.23      22.74       0.21    -0.27     16
  18       C     0.31     3.85     9.79      22.82       0.22     4.07     16
  19       O    -0.70   -18.34    17.23    -127.47      -2.20   -20.53     16
  20       O    -0.72   -20.47    17.23    -127.47      -2.20   -22.66     16
  21       C    -0.02    -0.09     9.74      22.52       0.22     0.13     16
  22       C    -0.07    -0.12    10.00      22.25       0.22     0.10     16
  23       C     0.18     2.06     7.29      22.77       0.17     2.23     16
  24       F    -0.10    -1.92    15.54      44.97       0.70    -1.23     16
  25       H     0.43     6.75     6.49     -92.71      -0.60     6.15     16
  26       H     0.14     6.25     5.60      -2.91      -0.02     6.24     16
  27       H     0.14     4.99     7.88      -2.91      -0.02     4.97     16
  28       H     0.18     3.24     8.06      -2.91      -0.02     3.21     16
  29       H     0.19     2.13     6.12      -2.91      -0.02     2.11     16
  30       H     0.34     7.58     8.90     -74.05      -0.66     6.92     16
  31       H     0.34     8.20     8.90     -74.05      -0.66     7.54     16
  32       H     0.21     0.15     7.76      -2.91      -0.02     0.13     16
  33       H     0.24    -1.66     8.06      -2.91      -0.02    -1.68     16
 Total:         -1.00   -93.94   318.62                 -3.32   -97.27